L317-0118 Screening compound: 3-[4-(5-chloro-1H-indol-2-yl)phenyl]-1-(4-methylphenyl)urea

L317-0118 Screening compound: 3-[4-(5-chloro-1H-indol-2-yl)phenyl]-1-(4-methylphenyl)urea
L317-0118 Screening compound: 3-[4-(5-chloro-1H-indol-2-yl)phenyl]-1-(4-methylphenyl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound L317-0118
3-[4-(5-chloro-1H-indol-2-yl)phenyl]-1-(4-methylphenyl)urea

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

L317-0118

Molecular Formula

C22H18ClN3O (C22 H18 ClN3 O)

Compound Name

3-[4-(5-chloro-1H-indol-2-yl)phenyl]-1-(4-methylphenyl)urea

IUPAC name

3-[4-(5-chloro-1H-indol-2-yl)phenyl]-1-(4-methylphenyl)urea

SMILES

Cc(cc1)ccc1NC(Nc(cc1)ccc1-c1cc(cc(cc2)Cl)c2[nH]1)=O

InChI

InChI=1S/C22H18ClN3O/c1-14-2-7-18(8-3-14)24-22(27)25-19-9-4-15(5-10-19)21-13-16-12-17(23)6-11-20(16)26-21/h2-13,26H,1H3,(H2,24,25,27)

InChI Key

SQSWARKBDNKYLC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15123666

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

375.86

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.921

Distribution Coefficient, logD

6.921

Water Solubility, LogSw

-6.46

Polar Surface Area

41.619

Acid Dissociation Constant (pKa)

13.51

Base Dissociation Constant (pKb)

1.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.50

L317-0118 in Drug Discovery

Included in Screening Libraries

Indole Derivatives (10091 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with L317-0118 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L317-0118?
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What is the minimum amount of L317-0118 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L317-0118
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L317-0118
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of L317-0118 available by request